Geometry & MOs

Info

ID:	18194
PubChem CID:	538870
Reduced:	N3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	263.126991
ΔH_f, kcal/mol:	-72.43
Dipole, Da:	8.16
IP(EA), eV:	-9.26(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[3-(N-acetylanilino)-1-aminopropylidene]amino] acetate

Drug info:

PubChemData

Smile

CC(=O)N(CCC(=NOC(=O)C)N)C1=CC=CC=C1

DOS

IR

Vibrations