Geometry & MOs

Info

ID:	399605
PubChem CID:	135041236
Reduced:	NSC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	225.036068
ΔH_f, kcal/mol:	25.72
Dipole, Da:	0.93
IP(EA), eV:	-8.58(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-azidophenyl)ethynyl]thiophene

Drug info:

PubChemData

Smile

CC(C)(C)NSC1=CC=C(C=C1)C=C

DOS

IR

Vibrations