Geometry & MOs

Info

ID:	5077
PubChem CID:	12554
Reduced:	N4O5H16C19 (1)
Stoich.:	A4B5C16D19 (1)
Weight, g/mol:	380.11207
ΔH_f, kcal/mol:	-4.39
Dipole, Da:	2.44
IP(EA), eV:	-8.99(-2.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-acetylimino-2-[2-[5-(dihydroxyamino)furan-2-yl]ethenyl]quinolin-6-ylidene]acetamide

Drug info:

PubChemData

Smile

CC(=O)N=C1C=CC2=NC(=CC(=NC(=O)C)C2=C1)C=CC3=CC=C(O3)N(O)O

DOS

IR

Vibrations