Geometry & MOs

Info

ID:	295238
PubChem CID:	117522782
Reduced:	ClN4H11C13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	252.137497
ΔH_f, kcal/mol:	86.23
Dipole, Da:	7.85
IP(EA), eV:	-9.3(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dimethylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carbonitrile

Drug info:

PubChemData

Smile

C1CN2C(=C(N=C2C3=CC=C(C=C3)Cl)C#N)CN1

DOS

IR

Vibrations