Geometry & MOs

Info

ID:	193977
PubChem CID:	78462762
Reduced:	N2O7C20H28 (1)
Stoich.:	A2B7C20D28 (1)
Weight, g/mol:	337.167794
ΔH_f, kcal/mol:	-306.9
Dipole, Da:	1.31
IP(EA), eV:	-9.89(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] 3-phenylbutanoate

Drug info:

PubChemData

Smile

CC1=NC(=C(C(C1C(=O)OC)C(=O)OCC(=O)NC2CCCCC2)C(=O)OC)C

DOS

IR

Vibrations