Geometry & MOs

Info

ID:	265463
PubChem CID:	103523572
Reduced:	BrNO3C15H24 (1)
Stoich.:	ABC3D15E24 (1)
Weight, g/mol:	355.99272
ΔH_f, kcal/mol:	-107.72
Dipole, Da:	2.42
IP(EA), eV:	-8.65(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-2,4-dimethoxyphenyl)-(3-chloropyridin-2-yl)methanamine

Drug info:

PubChemData

Smile

CC(C)C(C(C1=C(C(=C(C=C1)OC)Br)OC)NC)OC

DOS

IR

Vibrations