Geometry & MOs

Info

ID:	72443
PubChem CID:	48416181
Reduced:	N3O5C18H21 (1)
Stoich.:	A3B5C18D21 (1)
Weight, g/mol:	407.154429
ΔH_f, kcal/mol:	-158.19
Dipole, Da:	1.75
IP(EA), eV:	-8.84(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[[4-(difluoromethoxy)benzoyl]amino]methyl]-3-(4-ethoxyphenyl)propanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations