Geometry & MOs

Info

ID:	320030
PubChem CID:	126658007
Reduced:	O2N3C23H31 (1)
Stoich.:	A2B3C23D31 (1)
Weight, g/mol:	197.21435
ΔH_f, kcal/mol:	-68.08
Dipole, Da:	4.43
IP(EA), eV:	-9.03(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-3,3-di(propan-2-yl)azetidine

Drug info:

PubChemData

Smile

CCCN1C[C@H](C[C@H]2[C@H]1CC(=C)C(=O)C2)NC(=O)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations