Geometry & MOs

Info

ID:	175441
PubChem CID:	75906495
Reduced:	ClOSN4C24H29 (1)
Stoich.:	ABCD4E24F29 (1)
Weight, g/mol:	372.160456
ΔH_f, kcal/mol:	2.77
Dipole, Da:	7.96
IP(EA), eV:	-8.57(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[1-(4-chlorophenyl)-4-methylpentyl]amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NNC(=S)N2CCC(=O)NC(CCC(C)C)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations