Geometry & MOs

Info

ID:

185947

PubChem CID:

77373296

Reduced:

N3O6C34H35 (1)

Stoich.:

A3B6C34D35 (1)

Weight, g/mol:

660.290762

ΔHf, kcal/mol:

-153.32

Dipole, Da:

8.43

IP(EA), eV:

 -8.03(-2.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[amino-[1-[4,5-bis(phenylmethoxymethyl)oxolan-3-yl]-2-oxopyrimidin-4-yl]amino]-1-[4,5-bis(hydroxymethyl)oxolan-3-yl]pyrimidin-2-one

Drug info:

PubChemData

Smile

CC(C(=O)O)NC1=CC2=CC=CC=C2C=C1.CC(C(=O)O)NC1=CC=CC2=CC=CC=C21.C1=CC=C(C=C1)NCC(=O)O

DOS

IR

Vibrations