Geometry & MOs

Info

ID:	129901
PubChem CID:	51074227
Reduced:	O2F3N3H12C13 (1)
Stoich.:	A2B3C3D12E13 (1)
Weight, g/mol:	261.08235
ΔH_f, kcal/mol:	-213.81
Dipole, Da:	3.05
IP(EA), eV:	-9.34(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-(furan-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N(C=N2)CC(=O)NCC(F)(F)F

DOS

IR

Vibrations