Geometry & MOs

Info

ID:	360456
PubChem CID:	127301101
Reduced:	N2O2S2C17H22 (1)
Stoich.:	A2B2C2D17E22 (1)
Weight, g/mol:	367.099063
ΔH_f, kcal/mol:	-87.93
Dipole, Da:	2.65
IP(EA), eV:	-9.25(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(4-oxofuro[3,2-c]pyridin-5-yl)acetamide

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=CC=CS4

DOS

IR

Vibrations