Geometry & MOs

Info

ID:

397672

PubChem CID:

135030551

Reduced:

NO8C34H49 (1)

Stoich.:

AB8C34D49 (1)

Weight, g/mol:

285.136493

ΔHf, kcal/mol:

-383.26

Dipole, Da:

6.23

IP(EA), eV:

-9.36(-0.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2-phenylmethoxyphenyl) N-propan-2-ylcarbamate

Drug info:

PubChemData

Smile

CC[C@@H]1[C@@]([C@@H]([C@H]([C@H]([C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O)C)O)(C)O)C)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C)O)(C)O

DOS

IR

Vibrations