Geometry & MOs

Info

ID:	217305
PubChem CID:	85087585
Reduced:	SiO3C20H34 (1)
Stoich.:	AB3C20D34 (1)
Weight, g/mol:	348.9869
ΔH_f, kcal/mol:	-203.62
Dipole, Da:	1.96
IP(EA), eV:	-8.96(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-8-chloro-5-phenyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)OC1C(CCC(O1)C2=CC=CC=C2)O

DOS

IR

Vibrations