Geometry & MOs

Info

ID:	208899
PubChem CID:	80601106
Reduced:	NSC14H25 (1)
Stoich.:	ABC14D25 (1)
Weight, g/mol:	302.99286
ΔH_f, kcal/mol:	-24.15
Dipole, Da:	1.18
IP(EA), eV:	-8.51(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(thian-2-ylmethyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

C1CCSC(C1)CNCC2CC3CCC2C3

DOS

IR

Vibrations