Geometry & MOs

Info

ID:	265456
PubChem CID:	103522997
Reduced:	BrNO2C17H20 (1)
Stoich.:	ABC2D17E20 (1)
Weight, g/mol:	370.99238
ΔH_f, kcal/mol:	-36.03
Dipole, Da:	1.41
IP(EA), eV:	-8.85(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-4-chlorophenyl)-(3-bromo-2,4-dimethoxyphenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C)(C2=C(C(=C(C=C2)OC)Br)OC)N

DOS

IR

Vibrations