Geometry & MOs

Info

ID:	314181
PubChem CID:	126620812
Reduced:	SO2N4H18C23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	325.03275
ΔH_f, kcal/mol:	31.66
Dipole, Da:	7.48
IP(EA), eV:	-8.52(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-iodo-N-methyl-4-propan-2-ylnaphthalen-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C2=NC(=NN2)SCC(=O)O)C3=CC4=C(C=C3)C5=CC=CC=C5N4

DOS

IR

Vibrations