Geometry & MOs

Info

ID:	148499
PubChem CID:	53788162
Reduced:	ON3C25H37 (1)
Stoich.:	AB3C25D37 (1)
Weight, g/mol:	228.045426
ΔH_f, kcal/mol:	-64.65
Dipole, Da:	5.44
IP(EA), eV:	-7.95(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chloronaphthalen-1-yl)-1H-pyrazole

Drug info:

PubChemData

Smile

CC1CC2=CNC3=C4C(=CC(=C23)N([C@H](C(=O)N1)C(C)C)C)C(CCC4(C)C)(C)C

DOS

IR

Vibrations