Geometry & MOs

Info

ID:	121974
PubChem CID:	50788581
Reduced:	SN4O4C22H34 (1)
Stoich.:	AB4C4D22E34 (1)
Weight, g/mol:	393.208613
ΔH_f, kcal/mol:	-177.51
Dipole, Da:	2.95
IP(EA), eV:	-9.12(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cycloheptyl-2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCCN2CCCC2=O)CC(=O)N3CCNCC3)C

DOS

IR

Vibrations