Geometry & MOs

Info

ID:	173295
PubChem CID:	75620704
Reduced:	O2N3C22H25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	372.171689
ΔH_f, kcal/mol:	-7.4
Dipole, Da:	6.76
IP(EA), eV:	-8.99(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-cyclopropyl-N-(pyridin-2-ylmethyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)CC(=O)N(C)CC2=NC(=O)C3C=CC=CC3=N2

DOS

IR

Vibrations