Geometry & MOs

Info

ID:	32433
PubChem CID:	7825257
Reduced:	NO3H17C25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	230.094782
ΔH_f, kcal/mol:	5.57
Dipole, Da:	1.48
IP(EA), eV:	-8.96(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(4-chlorophenyl)methyl-(1,3-dihydroxy-2-methylpropan-2-yl)azanium

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

DOS

IR

Vibrations