Geometry & MOs

Info

ID:	296311
PubChem CID:	117567346
Reduced:	ON2C13H22 (1)
Stoich.:	AB2C13D22 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-40.33
Dipole, Da:	4.57
IP(EA), eV:	-7.97(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methoxy-5-methylphenyl)-2,2-dimethylbutane-1,4-diamine

Drug info:

PubChemData

Smile

CC(C)(CCNC1=CC(=CC=C1)OC)CN

DOS

IR

Vibrations