Geometry & MOs

Info

ID:	38337
PubChem CID:	8030679
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	416.209993
ΔH_f, kcal/mol:	-83.57
Dipole, Da:	7.32
IP(EA), eV:	-8.76(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(2S,4S)-1-(furan-2-carbonyl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]-2-methyl-N-phenylbutanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C(=O)[C@@H]2NC(=O)C)CCC(=O)C3=CC=CC=C3

DOS

IR

Vibrations