Geometry & MOs

Info

ID:	295460
PubChem CID:	117529946
Reduced:	SN2O2C13H14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	235.157229
ΔH_f, kcal/mol:	-39.31
Dipole, Da:	1.91
IP(EA), eV:	-9.76(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-dimethoxy-4-methylphenyl)-N-methylcyclobutan-1-amine

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)C2=CC=NC=C2)C(C)(C)C(=O)O

DOS

IR

Vibrations