Geometry & MOs

Info

ID:	414521
PubChem CID:	135087480
Reduced:	N3O3C20H27 (1)
Stoich.:	A3B3C20D27 (1)
Weight, g/mol:	365.140927
ΔH_f, kcal/mol:	-96.64
Dipole, Da:	5.84
IP(EA), eV:	-9.42(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4aR,6R,7aR)-2-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridin-6-yl]-N-methyl-4-sulfamoylbenzamide

Drug info:

PubChemData

Smile

C1C[C@@]2(CCN(C[C@H]2N(C1)CC3=CC=CC=C3C#N)C(=O)CCO)CO

DOS

IR

Vibrations