Geometry & MOs

Info

ID:	411489
PubChem CID:	135084320
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	218.112692
ΔH_f, kcal/mol:	-17.84
Dipole, Da:	3.43
IP(EA), eV:	-8.58(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCNC(=O)NC1=C(C=CC(=C1)OC)C#C

DOS

IR

Vibrations