Geometry & MOs

Info

ID:	3213
PubChem CID:	9336
Reduced:	BrNOC10H16 (1)
Stoich.:	ABCD10E16 (1)
Weight, g/mol:	245.04153
ΔH_f, kcal/mol:	-28.33
Dipole, Da:	12.64
IP(EA), eV:	-8.02(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl-(3-hydroxyphenyl)-dimethylazanium;bromide

Drug info:

PubChemData

Smile

CC[N+](C)(C)C1=CC(=CC=C1)O.[Br-]

DOS

IR

Vibrations