Geometry & MOs

Info

ID:	122803
PubChem CID:	50822270
Reduced:	ClFSN2O3C18H18 (1)
Stoich.:	ABCD2E3F18G18 (1)
Weight, g/mol:	440.213364
ΔH_f, kcal/mol:	-117.28
Dipole, Da:	3.07
IP(EA), eV:	-9.15(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylmethyl)-1-[4-[(2,5-dimethylphenyl)sulfonylamino]phenyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)C1(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations