Geometry & MOs

Info

ID:	205555
PubChem CID:	80120378
Reduced:	NO4C16H17 (1)
Stoich.:	AB4C16D17 (1)
Weight, g/mol:	231.021769
ΔH_f, kcal/mol:	-123.98
Dipole, Da:	5.48
IP(EA), eV:	-8.7(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dichlorophenyl)methyl]oxetan-3-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1N)C(=O)O)OCC2=CC(=CC=C2)OC

DOS

IR

Vibrations