Geometry & MOs

Info

ID:	369131
PubChem CID:	127331363
Reduced:	N2O2C9H11 (2)
Stoich.:	A2B2C9D11 (2)
Weight, g/mol:	329.119798
ΔH_f, kcal/mol:	-114.89
Dipole, Da:	7.14
IP(EA), eV:	-9.13(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(oxolan-3-ylmethyl)pyrazol-3-yl]-2,3-dihydro-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=O)C(=N1)C(=O)NC(C)C(=O)N3CCOCC3

DOS

IR

Vibrations