Geometry & MOs

Info

ID:	62083
PubChem CID:	26717497
Reduced:	SN4O4C23H28 (1)
Stoich.:	AB4C4D23E28 (1)
Weight, g/mol:	323.047984
ΔH_f, kcal/mol:	-135.47
Dipole, Da:	5.84
IP(EA), eV:	-8.7(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)NC(=O)N4

DOS

IR

Vibrations