Geometry & MOs

Info

ID:	174583
PubChem CID:	75788380
Reduced:	O2N3C24H31 (1)
Stoich.:	A2B3C24D31 (1)
Weight, g/mol:	479.04021
ΔH_f, kcal/mol:	-24.61
Dipole, Da:	5.28
IP(EA), eV:	-8.17(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromofuran-2-yl)methyl]-N-(1,1-dioxothiolan-3-yl)-5-propan-2-yl-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC2=C(C=C1)OC(=C2)C(=O)NCC(C3=CC=C(C=C3)N(C)C)N(C)C

DOS

IR

Vibrations