Geometry & MOs

Info

ID:	347522
PubChem CID:	127272377
Reduced:	O2N3C23H33 (1)
Stoich.:	A2B3C23D33 (1)
Weight, g/mol:	394.203862
ΔH_f, kcal/mol:	-88.14
Dipole, Da:	6.41
IP(EA), eV:	-8.97(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylcyclohexyl)-2-oxo-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethanesulfonamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)NC2CCN(C2)CC3=CC=CC=C3)C(=O)N4CCCC4

DOS

IR

Vibrations