Geometry & MOs

Info

ID:	412745
PubChem CID:	135085659
Reduced:	OC13H16 (1)
Stoich.:	AB13C16 (1)
Weight, g/mol:	240.066555
ΔH_f, kcal/mol:	-22.32
Dipole, Da:	3.35
IP(EA), eV:	-9.74(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[(Z)-[chloro-(4-methylphenyl)methylidene]amino]carbamate

Drug info:

PubChemData

Smile

CC(C)/C(=C\C(=O)C1=CC=CC=C1)/C

DOS

IR

Vibrations