Geometry & MOs

Info

ID:	74011
PubChem CID:	48421351
Reduced:	O3N4C15H22 (1)
Stoich.:	A3B4C15D22 (1)
Weight, g/mol:	365.177313
ΔH_f, kcal/mol:	-119.11
Dipole, Da:	2.62
IP(EA), eV:	-8.5(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-[(8-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)amino]-1,3-thiazol-4-yl]acetate

Drug info:

PubChemData

Smile

CCN(CC(C)O)C(=O)NC1=CC(=CC=C1)N2CCNC2=O

DOS

IR

Vibrations