Geometry & MOs

Info

ID:	131956
PubChem CID:	51284416
Reduced:	NO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	385.142641
ΔH_f, kcal/mol:	-93.39
Dipole, Da:	4.84
IP(EA), eV:	-8.73(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyphenyl)-3-(2-methoxyphenyl)-1-phenylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)O)C(=O)NC2=CC=CC=C2O

DOS

IR

Vibrations