Geometry & MOs

Info

ID:	37744
PubChem CID:	8023996
Reduced:	NO4C22H29 (1)
Stoich.:	AB4C22D29 (1)
Weight, g/mol:	381.155178
ΔH_f, kcal/mol:	-189.67
Dipole, Da:	5.71
IP(EA), eV:	-9.42(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-diethoxyphenyl)ethyl]-4-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(=O)O[C@@H](C)C(=O)NC23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations