Geometry & MOs

Info

ID:	365054
PubChem CID:	127316735
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	369.241627
ΔH_f, kcal/mol:	-29.93
Dipole, Da:	5.47
IP(EA), eV:	-8.82(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)phenyl]methyl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C3=NOC(=C3)C

DOS

IR

Vibrations