Geometry & MOs

Info

ID:	241045
PubChem CID:	93621350
Reduced:	N2O5C18H24 (1)
Stoich.:	A2B5C18D24 (1)
Weight, g/mol:	300.093249
ΔH_f, kcal/mol:	-139.52
Dipole, Da:	6.43
IP(EA), eV:	-8.59(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)N[C@H](C)C2=CC(=C(C=C2)OCCOC)OC

DOS

IR

Vibrations