Geometry & MOs

Info

ID:	365236
PubChem CID:	127317084
Reduced:	ON2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	338.174276
ΔH_f, kcal/mol:	-124.46
Dipole, Da:	4.14
IP(EA), eV:	-8.74(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)NC(=O)CN2CC3CCCN3CC2C

DOS

IR

Vibrations