Geometry & MOs

Info

ID:	243323
PubChem CID:	99218326
Reduced:	N3O5C18H23 (1)
Stoich.:	A3B5C18D23 (1)
Weight, g/mol:	404.158351
ΔH_f, kcal/mol:	-144.68
Dipole, Da:	4.91
IP(EA), eV:	-9.0(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3,5-dimethoxyphenyl)methyl-[3-(furan-3-carbonylamino)propanoyl]amino]acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)N(CC1=CC(=CC(=C1)OC)OC)CC(=O)OC)N2C=CC=N2

DOS

IR

Vibrations