Geometry & MOs

Info

ID:

75469

PubChem CID:

48423514

Reduced:

N3O4C23H27 (1)

Stoich.:

A3B4C23D27 (1)

Weight, g/mol:

370.189257

ΔHf, kcal/mol:

-131.32

Dipole, Da:

5.6

IP(EA), eV:

-9.31(-0.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)C(=O)CC3=CC=CC=C3

DOS

IR

Vibrations