Geometry & MOs

Info

ID:	407713
PubChem CID:	135080468
Reduced:	ClO2H11C12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	183.162314
ΔH_f, kcal/mol:	-44.27
Dipole, Da:	3.86
IP(EA), eV:	-9.53(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-tert-butyl-5-methylhex-2-enamide

Drug info:

PubChemData

Smile

COC(=O)/C=C(/C=C/C1=CC=CC=C1)\Cl

DOS

IR

Vibrations