Geometry & MOs

Info

ID:	206327
PubChem CID:	80232318
Reduced:	BrSN2O2H7C9 (1)
Stoich.:	ABC2D2E7F9 (1)
Weight, g/mol:	271.982941
ΔH_f, kcal/mol:	-34.95
Dipole, Da:	6.04
IP(EA), eV:	-9.39(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3-dichlorophenyl)-(4-methylthiophen-3-yl)methanol

Drug info:

PubChemData

Smile

CC1=CSC=C1C2=NC(=C(C(=O)N2)Br)O

DOS

IR

Vibrations