Geometry & MOs

Info

ID:	26098
PubChem CID:	638430
Reduced:	BrI2C8H13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	195.053158
ΔH_f, kcal/mol:	20.19
Dipole, Da:	1.67
IP(EA), eV:	-9.4(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-4-[(E)-2-nitroethenyl]phenol

Drug info:

PubChemData

Smile

CCCCCC/C(=C(\Br)/I)/I

DOS

IR

Vibrations