Geometry & MOs

Info

ID:	355252
PubChem CID:	127288184
Reduced:	SN4O4C14H22 (1)
Stoich.:	AB4C4D14E22 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-124.5
Dipole, Da:	7.88
IP(EA), eV:	-9.82(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2(CCCC2)NC(=O)N(C)C3CCS(=O)(=O)C3

DOS

IR

Vibrations