Geometry & MOs

Info

ID:	379800
PubChem CID:	134464934
Reduced:	NOC11H13 (2)
Stoich.:	ABC11D13 (2)
Weight, g/mol:	352.178693
ΔH_f, kcal/mol:	-72.97
Dipole, Da:	3.31
IP(EA), eV:	-8.27(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(cyclohexylamino)-6-methylbenzoyl]amino]benzoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC2CCCCC2)C(=O)NC3=CC=CC=C3C(=O)C

DOS

IR

Vibrations