Geometry & MOs

Info

ID:	153537
PubChem CID:	56312777
Reduced:	FO2N3C22H24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	364.189926
ΔH_f, kcal/mol:	-76.41
Dipole, Da:	2.19
IP(EA), eV:	-8.92(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-5-N-(3-phenylbutyl)-3,4-dihydropyrazole-3,5-dicarboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2C(=O)CCC(=N2)C(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations