Geometry & MOs

Info

ID:	357674
PubChem CID:	127294348
Reduced:	O2N4C21H30 (1)
Stoich.:	A2B4C21D30 (1)
Weight, g/mol:	308.221226
ΔH_f, kcal/mol:	-67.34
Dipole, Da:	4.92
IP(EA), eV:	-8.61(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

C1CC2CN(CCN2C1)CC(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations