Geometry & MOs

Info

ID:	144795
PubChem CID:	53414710
Reduced:	N2O4C9H16 (1)
Stoich.:	A2B4C9D16 (1)
Weight, g/mol:	319.178358
ΔH_f, kcal/mol:	-180.98
Dipole, Da:	4.04
IP(EA), eV:	-10.15(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpent-3-enoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)(C(=O)O)N

DOS

IR

Vibrations