Geometry & MOs

Info

ID:	183518
PubChem CID:	77033888
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	234.136828
ΔH_f, kcal/mol:	-69.41
Dipole, Da:	2.67
IP(EA), eV:	-8.24(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-hydroxyimino-2,3-dihydroquinolin-1-yl)butan-1-ol

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)N1CCC(=NO)C2=CC=CC=C21

DOS

IR

Vibrations