Geometry & MOs

Info

ID:	292535
PubChem CID:	115354272
Reduced:	BrOH17C19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	475.79037
ΔH_f, kcal/mol:	1.97
Dipole, Da:	3.19
IP(EA), eV:	-9.15(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-bromonaphthalen-2-yl)-(4,5-dibromothiophen-2-yl)methanol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C2=CC3=C(C=C2)C=C(C=C3)Br)O)C

DOS

IR

Vibrations