Geometry & MOs

Info

ID:	366380
PubChem CID:	127319861
Reduced:	O3N5C14H19 (1)
Stoich.:	A3B5C14D19 (1)
Weight, g/mol:	369.135638
ΔH_f, kcal/mol:	-79.31
Dipole, Da:	8.32
IP(EA), eV:	-9.52(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-chlorophenyl)-3,5-dimethylpyrazol-4-yl]-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanone

Drug info:

PubChemData

Smile

CCN1CCN(C(=O)C1=O)CC(=O)N2CCN3C=CN=C3C2

DOS

IR

Vibrations