Geometry & MOs

Info

ID:	380649
PubChem CID:	134971165
Reduced:	NO5C17H21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	328.105922
ΔH_f, kcal/mol:	-85.78
Dipole, Da:	6.29
IP(EA), eV:	-8.99(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-3-(5-hydroxypyridin-2-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)/C=C(\C2=CCCCC2)/[N+](=O)[O-]

DOS

IR

Vibrations