Geometry & MOs

Info

ID:	366046
PubChem CID:	127319362
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	394.203862
ΔH_f, kcal/mol:	-96.78
Dipole, Da:	1.69
IP(EA), eV:	-9.11(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-[4-(1-methylpyrrolidine-2-carbonyl)piperazin-1-yl]ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1C(=O)NCCN1C(=O)C2CCCN2C

DOS

IR

Vibrations