Geometry & MOs

Info

ID:	401296
PubChem CID:	135050836
Reduced:	O2N3H15C16 (1)
Stoich.:	A2B3C15D16 (1)
Weight, g/mol:	269.105193
ΔH_f, kcal/mol:	82.79
Dipole, Da:	10.13
IP(EA), eV:	-8.32(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[(Z)-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-phenylmethyl]amino] acetate

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)/[N+](=C/C2=CC=CC3=NOC=C32)/[O-]

DOS

IR

Vibrations