Geometry & MOs

Info

ID:	332376
PubChem CID:	127250662
Reduced:	O3N6C23H24 (1)
Stoich.:	A3B6C23D24 (1)
Weight, g/mol:	438.226705
ΔH_f, kcal/mol:	-21.41
Dipole, Da:	6.19
IP(EA), eV:	-9.0(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-[4-[2-(1-hydroxycyclohexyl)acetyl]morpholin-2-yl]pyridin-3-yl]-N-methylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C(=O)N2CCOC(C2)C3=NC=C(C=C3)C4=CN=C(C=C4)C(=O)NC

DOS

IR

Vibrations