Geometry & MOs

Info

ID:	200050
PubChem CID:	79338389
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-86.78
Dipole, Da:	3.18
IP(EA), eV:	-9.01(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chloro-4-methoxyphenyl)methylidene]-N,3-dimethylbutan-1-amine

Drug info:

PubChemData

Smile

C1CCC(C(C1)CN)OC(=O)NC2=CC=CC=C2

DOS

IR

Vibrations