Geometry & MOs

Info

ID:	368498
PubChem CID:	127329230
Reduced:	O2N3C16H25 (1)
Stoich.:	A2B3C16D25 (1)
Weight, g/mol:	264.129634
ΔH_f, kcal/mol:	-55.36
Dipole, Da:	4.01
IP(EA), eV:	-8.86(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-thiophen-3-ylmethanone

Drug info:

PubChemData

Smile

CCC1=NOC(=C1C(=O)N2CC3CCCCN3CC2C)C

DOS

IR

Vibrations