Geometry & MOs

Info

ID:	271152
PubChem CID:	103645450
Reduced:	NO2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	322.200491
ΔH_f, kcal/mol:	-160.36
Dipole, Da:	3.49
IP(EA), eV:	-8.68(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[[4-(dimethylamino)-2-methoxypyridin-3-yl]amino]azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)NC2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations