Geometry & MOs

Info

ID:	365116
PubChem CID:	127316858
Reduced:	ON3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	385.12269
ΔH_f, kcal/mol:	-9.55
Dipole, Da:	5.04
IP(EA), eV:	-8.76(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-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)C3=CC=CC=N3

DOS

IR

Vibrations