Geometry & MOs

Info

ID:	245999
PubChem CID:	103034626
Reduced:	N2O2C17H28 (1)
Stoich.:	A2B2C17D28 (1)
Weight, g/mol:	277.167794
ΔH_f, kcal/mol:	-102.88
Dipole, Da:	4.29
IP(EA), eV:	-8.56(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxy-3-methylbutyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid

Drug info:

PubChemData

Smile

CCNC1CCCC2=C1C=CC(=O)N2CCC(C)(C)OC

DOS

IR

Vibrations