Geometry & MOs

Info

ID:	362535
PubChem CID:	127308150
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-32.55
Dipole, Da:	3.5
IP(EA), eV:	-8.79(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)N2CCN3CCCC3C2)C

DOS

IR

Vibrations