Geometry & MOs

Info

ID:	72354
PubChem CID:	48416079
Reduced:	OSN5C14H15 (1)
Stoich.:	ABC5D14E15 (1)
Weight, g/mol:	407.154429
ΔH_f, kcal/mol:	57.6
Dipole, Da:	4.57
IP(EA), eV:	-9.16(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=NSN=C3

DOS

IR

Vibrations