Geometry & MOs

Info

ID:	89693
PubChem CID:	49963801
Reduced:	NOSH13C15 (1)
Stoich.:	ABCD13E15 (1)
Weight, g/mol:	280.04217
ΔH_f, kcal/mol:	19.43
Dipole, Da:	2.63
IP(EA), eV:	-9.18(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3-dichlorophenyl)-(3,5-dimethylphenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(C2=NC3=CC=CC=C3S2)O

DOS

IR

Vibrations