Geometry & MOs

Info

ID:	354239
PubChem CID:	127286203
Reduced:	ON3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	393.177645
ΔH_f, kcal/mol:	-47.62
Dipole, Da:	3.05
IP(EA), eV:	-8.74(1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[5-(trifluoromethyl)pyrazol-1-yl]phenyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1CC1)NC(=O)N2CCN3CCCCC3C2

DOS

IR

Vibrations