Geometry & MOs

Info

ID:	292564
PubChem CID:	116933598
Reduced:	SN2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-10.73
Dipole, Da:	3.02
IP(EA), eV:	-8.5(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-4,6-dimethylphenyl)-3-methylbutane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)SC1=CC=C(C=C1)C(CC(C)(C)N)N

DOS

IR

Vibrations