Geometry & MOs

Info

ID:	445484
PubChem CID:	135267348
Reduced:	SN2O2C22H32 (1)
Stoich.:	AB2C2D22E32 (1)
Weight, g/mol:	184.062361
ΔH_f, kcal/mol:	-59.67
Dipole, Da:	2.2
IP(EA), eV:	-8.18(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-bis(difluoromethyl)-2-methyl-1,3-dihydropyrazole

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N2CCCCC2)C(C3=CC=C(O3)C)NS(=O)C(C)(C)C

DOS

IR

Vibrations