Geometry & MOs

Info

ID:	354695
PubChem CID:	127287394
Reduced:	SO2N5C19H33 (1)
Stoich.:	AB2C5D19E33 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-73.41
Dipole, Da:	2.92
IP(EA), eV:	-8.67(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methyl-1H-indol-3-yl)-N-(3-morpholin-4-ylbutan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)CN2CCN(CC2)C(=O)NC(C)C(C)N3CCOCC3

DOS

IR

Vibrations