Geometry & MOs

Info

ID:	362706
PubChem CID:	127309183
Reduced:	O3N4C17H28 (1)
Stoich.:	A3B4C17D28 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-119.89
Dipole, Da:	7.3
IP(EA), eV:	-8.79(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2CN(CCO2)C(=O)NCC3CCCCO3)C

DOS

IR

Vibrations