Geometry & MOs

Info

ID:	187251
PubChem CID:	77551091
Reduced:	NOC22H31 (1)
Stoich.:	ABC22D31 (1)
Weight, g/mol:	421.147156
ΔH_f, kcal/mol:	-36.63
Dipole, Da:	4.75
IP(EA), eV:	-8.19(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[7-[[4-(1-fluoropropan-2-yl)phenyl]sulfonylamino]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-3-yl]propanamide

Drug info:

PubChemData

Smile

CCC12CCC3C4CCC(=CC4=CCC3C1CCC2(C)C#N)OC

DOS

IR

Vibrations