Geometry & MOs

Info

ID:	72491
PubChem CID:	48416233
Reduced:	NO6C23H29 (1)
Stoich.:	AB6C23D29 (1)
Weight, g/mol:	305.162708
ΔH_f, kcal/mol:	-219.39
Dipole, Da:	4.41
IP(EA), eV:	-8.48(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(cyclopropanecarbonylamino)methyl]-3-(4-ethoxyphenyl)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2=CC(=C(C=C2)OC)OCC)C(=O)OC

DOS

IR

Vibrations