Geometry & MOs

Info

ID:	126515
PubChem CID:	50967135
Reduced:	N2O3C17H22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	346.156039
ΔH_f, kcal/mol:	-94.29
Dipole, Da:	4.85
IP(EA), eV:	-8.61(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)ethyl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CCOC1=CC=CC(=C1)C)C(=O)C2=C(N=C(O2)C)C

DOS

IR

Vibrations