Geometry & MOs

Info

ID:	38050
PubChem CID:	8026627
Reduced:	OCl2N2H21C22 (1)
Stoich.:	AB2C2D21E22 (1)
Weight, g/mol:	366.119127
ΔH_f, kcal/mol:	26.44
Dipole, Da:	5.84
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.989220
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2-methoxyphenyl)acetyl]amino]-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)Cl)Cl)[NH2+]CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations