Geometry & MOs

Info

ID:	354197
PubChem CID:	127286161
Reduced:	N2O2C10H15 (2)
Stoich.:	A2B2C10D15 (2)
Weight, g/mol:	393.216475
ΔH_f, kcal/mol:	-160.3
Dipole, Da:	3.66
IP(EA), eV:	-7.96(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(phenylcarbamoylamino)phenyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3=O)OC

DOS

IR

Vibrations