Geometry & MOs

Info

ID:	442608
PubChem CID:	135253306
Reduced:	N3C17H23 (1)
Stoich.:	A3B17C23 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	46.41
Dipole, Da:	3.52
IP(EA), eV:	-8.12(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylbut-1-enyl)-2-(4-methoxyphenyl)-5-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CCC(=CNC1=CC(=NN1C2=CC=C(C=C2)C)C)CC

DOS

IR

Vibrations