Geometry & MOs

Info

ID:	448866
PubChem CID:	135294157
Reduced:	NPO6C24H28 (1)
Stoich.:	ABC6D24E28 (1)
Weight, g/mol:	255.183444
ΔH_f, kcal/mol:	-221.74
Dipole, Da:	4.13
IP(EA), eV:	-7.87(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 6-[methyl(prop-2-enoyl)amino]hexanoate

Drug info:

PubChemData

Smile

CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=C)C=C3O2)P(=O)(OC)OCCCC(=O)OCC=C

DOS

IR

Vibrations