Geometry & MOs

Info

ID:	241049
PubChem CID:	93621377
Reduced:	N3O3C16H17 (1)
Stoich.:	A3B3C16D17 (1)
Weight, g/mol:	348.147393
ΔH_f, kcal/mol:	-61.68
Dipole, Da:	3.02
IP(EA), eV:	-9.01(-0.78)
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]-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C(=O)N[C@@H](C)C2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations