Geometry & MOs

Info

ID:	383611
PubChem CID:	134975423
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	186.115698
ΔH_f, kcal/mol:	-37.27
Dipole, Da:	4.09
IP(EA), eV:	-8.94(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-4-(2-phenylethyl)-1H-pyrazole

Drug info:

PubChemData

Smile

CCC(C)C1=C(N(NC1=O)C2=CC=CC=C2)O

DOS

IR

Vibrations