Geometry & MOs

Info

ID:	124456
PubChem CID:	50884683
Reduced:	BrN2O5C18H21 (1)
Stoich.:	AB2C5D18E21 (1)
Weight, g/mol:	391.07831
ΔH_f, kcal/mol:	-170.91
Dipole, Da:	3.86
IP(EA), eV:	-8.77(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-bromo-5-methoxy-4-(2-methylpropoxy)phenyl]-N-(4-methoxyphenyl)methanimine

Drug info:

PubChemData

Smile

CC(C)COC1=C(C=C(C=C1Br)C=C2C(=O)N(C(=O)N(C2=O)C)C)OC

DOS

IR

Vibrations