Geometry & MOs

Info

ID:	154382
PubChem CID:	56313805
Reduced:	NOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	337.15904
ΔH_f, kcal/mol:	17.5
Dipole, Da:	0.94
IP(EA), eV:	-9.49(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-N-(3-phenylbutyl)pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=CC(=NO1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations