Geometry & MOs

Info

ID:	345856
PubChem CID:	127270156
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	388.182064
ΔH_f, kcal/mol:	-41.45
Dipole, Da:	2.98
IP(EA), eV:	-8.86(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(thiomorpholine-4-carbonyl)cyclohexyl]-3,4-dihydro-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1C(=O)N2CCSCC2)NC(=O)C3=NC4=CC=CC=C4N=C3

DOS

IR

Vibrations