Geometry & MOs

Info

ID:	332974
PubChem CID:	127251398
Reduced:	O3N5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	442.211724
ΔH_f, kcal/mol:	-37.73
Dipole, Da:	3.39
IP(EA), eV:	-9.2(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[6-methyl-4-(1-methylpyrazol-4-yl)pyridin-2-yl]morpholin-4-yl]-N-quinolin-6-ylacetamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)N2CCOC(C2)C3=NC(=CC(=C3)C4=CN=C(N=C4)N)C)OC

DOS

IR

Vibrations