Geometry & MOs

Info

ID:	322907
PubChem CID:	126671561
Reduced:	ClSF2H7C12 (1)
Stoich.:	ABC2D7E12 (1)
Weight, g/mol:	201.01531
ΔH_f, kcal/mol:	-55.68
Dipole, Da:	1.02
IP(EA), eV:	-8.82(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-6-propan-2-yl-1,2-dihydropyridine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)S)C2=C(C=C(C=C2Cl)F)F

DOS

IR

Vibrations