Geometry & MOs

Info

ID:	142893
PubChem CID:	53110354
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	393.208613
ΔH_f, kcal/mol:	-78.88
Dipole, Da:	4.35
IP(EA), eV:	-8.83(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[1-(4-ethylpiperazine-1-carbonyl)cyclohexyl]phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC=C(C=C1)C2(CCCCC2)C(=O)NC3CC3

DOS

IR

Vibrations