Geometry & MOs

Info

ID:	36469
PubChem CID:	8007173
Reduced:	O2F3N3H12C17 (1)
Stoich.:	A2B3C3D12E17 (1)
Weight, g/mol:	382.098728
ΔH_f, kcal/mol:	-172.98
Dipole, Da:	6.75
IP(EA), eV:	-9.14(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-2-(benzenesulfonyl)-3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(C(=O)N2)C3=CC=CC=C3NC(=O)C(F)(F)F

DOS

IR

Vibrations