Geometry & MOs

Info

ID:	435268
PubChem CID:	135187322
Reduced:	N2O2C23H24 (1)
Stoich.:	A2B2C23D24 (1)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	40.5
Dipole, Da:	7.94
IP(EA), eV:	-9.53(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(N-methanimidoylanilino)benzoate

Drug info:

PubChemData

Smile

CC1(C2=CCN(C(=O)[C@@]2(C=C(C1=O)C#N)C3=CC=CC=C3)C4CCCC4)C

DOS

IR

Vibrations