Geometry & MOs

Info

ID:	365032
PubChem CID:	127316682
Reduced:	SN3O3C20H31 (1)
Stoich.:	AB3C3D20E31 (1)
Weight, g/mol:	379.192963
ΔH_f, kcal/mol:	-127.27
Dipole, Da:	6.29
IP(EA), eV:	-8.63(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethyl-N-[3-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-3-oxopropyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)[C@H](C(C)C)NS(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations