Geometry & MOs

Info

ID:	354241
PubChem CID:	127286205
Reduced:	OSN4C14H24 (1)
Stoich.:	ABC4D14E24 (1)
Weight, g/mol:	384.252526
ΔH_f, kcal/mol:	-38.23
Dipole, Da:	4.44
IP(EA), eV:	-8.91(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCN1CCC(C1)CNC(=O)NCC2=C(N=CS2)C

DOS

IR

Vibrations