Geometry & MOs

Info

ID:	331709
PubChem CID:	127249792
Reduced:	SO2N6C23H24 (1)
Stoich.:	AB2C6D23E24 (1)
Weight, g/mol:	447.22704
ΔH_f, kcal/mol:	35.23
Dipole, Da:	4.2
IP(EA), eV:	-8.56(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dihydro-2H-quinolin-1-yl)-1-[2-[6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridin-2-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2N1CC(=O)N3CCOC(C3)C4=NC(=CC=C4)NC5=NN=C(S5)C

DOS

IR

Vibrations