Geometry & MOs

Info

ID:	157312
PubChem CID:	56422867
Reduced:	NO2C10H11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	439.146681
ΔH_f, kcal/mol:	-133.05
Dipole, Da:	5.04
IP(EA), eV:	-8.67(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-diphenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]-3,4-dihydropyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCC2=C3C(=CC=C2)OCCO3)C

DOS

IR

Vibrations