Geometry & MOs

Info

ID:	72456
PubChem CID:	48416195
Reduced:	N2O5C22H26 (1)
Stoich.:	A2B5C22D26 (1)
Weight, g/mol:	369.194008
ΔH_f, kcal/mol:	-190.4
Dipole, Da:	4.55
IP(EA), eV:	-8.65(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations