Geometry & MOs

Info

ID:	138558
PubChem CID:	52384921
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	235.181038
ΔH_f, kcal/mol:	-4.43
Dipole, Da:	4.74
IP(EA), eV:	-9.14(0.22)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2-anilino-2-oxoethyl)-hexylazanium

Drug info:

PubChemData

Smile

CC[C@H](C)N1C(=CC=N1)NC(=O)CC2=CC=CC(=C2)C

DOS

IR

Vibrations