Geometry & MOs

Info

ID:	367940
PubChem CID:	127326114
Reduced:	SO2N4C19H30 (1)
Stoich.:	AB2C4D19E30 (1)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-83.12
Dipole, Da:	3.24
IP(EA), eV:	-8.59(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-methylcyclohexyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)CC(=O)NC(=O)NCC3=CC=CS3

DOS

IR

Vibrations