Geometry & MOs

Info

ID:	399142
PubChem CID:	135038178
Reduced:	BrNOC15H16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	292.149471
ΔH_f, kcal/mol:	-9.53
Dipole, Da:	1.46
IP(EA), eV:	-8.06(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-methoxy-2-methyl-5-phenyl-5-trimethylsilyloxypent-1-en-3-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)NCC2=CC=CC=C2Br)O)C

DOS

IR

Vibrations