Geometry & MOs

Info

ID:	132730
PubChem CID:	51408507
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	371.17461
ΔH_f, kcal/mol:	-25.27
Dipole, Da:	5.38
IP(EA), eV:	-9.04(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[N-[2-(1H-imidazol-5-yl)ethyl]-C-methylcarbonimidoyl]-2,5-diphenyl-4H-pyrazol-3-one

Drug info:

PubChemData

Smile

C1CC[C@@H]2[C@H](C1)N/C(=C/C(=O)C3=CC=CC=C3)/N2O

DOS

IR

Vibrations