Geometry & MOs

Info

ID:	354242
PubChem CID:	127286206
Reduced:	ON2C11H16 (2)
Stoich.:	AB2C11D16 (2)
Weight, g/mol:	376.189926
ΔH_f, kcal/mol:	-91.34
Dipole, Da:	7.77
IP(EA), eV:	-8.95(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)NC(=O)N3CCN4CCCCC4C3

DOS

IR

Vibrations