Geometry & MOs

Info

ID:	407158
PubChem CID:	135079456
Reduced:	Br2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-114.17
Dipole, Da:	2.75
IP(EA), eV:	-9.14(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(3-methyl-2,4-dioxo-4-phenylbutyl)carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C(CCBr)Br)C(C)(C)C

DOS

IR

Vibrations