Geometry & MOs

Info

ID:	51129
PubChem CID:	12013753
Reduced:	ClNO3H22C26 (1)
Stoich.:	ABC3D22E26 (1)
Weight, g/mol:	700.260504
ΔH_f, kcal/mol:	3.91
Dipole, Da:	5.32
IP(EA), eV:	-9.0(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(4-chlorophenyl)-2,3-diphenyl-3,4-dihydropyrazol-4-yl]-[5-(4-methoxyphenyl)-4-methyl-2,3-diphenyl-3H-pyrazol-4-yl]methanone

Drug info:

PubChemData

Smile

C/C(=C/C1=CC=CC=C1)/C(=O)C2C(ON=C2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

DOS

IR

Vibrations