Geometry & MOs

Info

ID:	200845
PubChem CID:	79452646
Reduced:	NSO2C11H23 (1)
Stoich.:	ABC2D11E23 (1)
Weight, g/mol:	245.21435
ΔH_f, kcal/mol:	-107.91
Dipole, Da:	8.24
IP(EA), eV:	-9.63(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylpropyl)-3-[(4-propan-2-ylphenyl)methyl]azetidine

Drug info:

PubChemData

Smile

CC(C)CC1(CNC1)CCCS(=O)(=O)C

DOS

IR

Vibrations