Geometry & MOs

Info

ID:	231848
PubChem CID:	87574770
Reduced:	FeNO4C7H13 (1)
Stoich.:	ABC4D7E13 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-111.83
Dipole, Da:	15.16
IP(EA), eV:	-8.25(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(butoxycarbonylamino) 3-phenylpropanoate

Drug info:

PubChemData

Smile

C[N+](C)(C)CCOC(=O)C(=O)[O-].[Fe]

DOS

IR

Vibrations