Geometry & MOs

Info

ID:	198514
PubChem CID:	79112976
Reduced:	NO2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-66.9
Dipole, Da:	1.68
IP(EA), eV:	-9.06(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pent-4-enoxy-5,6,7,8-tetrahydroquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)NCC1=CC=CC=C1OCCOCCCC=C

DOS

IR

Vibrations