Geometry & MOs

Info

ID:	257223
PubChem CID:	103144489
Reduced:	OSN2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	274.087291
ΔH_f, kcal/mol:	-55.93
Dipole, Da:	4.08
IP(EA), eV:	-8.0(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)-4-chlorobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)CC2CCSCC2)C)N

DOS

IR

Vibrations