Geometry & MOs

Info

ID:	190319
PubChem CID:	77984478
Reduced:	N3O5C31H35 (1)
Stoich.:	A3B5C31D35 (1)
Weight, g/mol:	300.00111
ΔH_f, kcal/mol:	-150.17
Dipole, Da:	4.29
IP(EA), eV:	-8.87(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-3-methyl-1-phenylpent-2-en-1-one

Drug info:

PubChemData

Smile

CCOC(=O)COC1=CC=C(C=C1)CNC(=O)C2CCCN2C(=O)C(CC3=CC=C(C=C3)C4=CC=CC=C4)N

DOS

IR

Vibrations