Geometry & MOs

Info

ID:	202572
PubChem CID:	79689040
Reduced:	OSN3C8H11 (1)
Stoich.:	ABC3D8E11 (1)
Weight, g/mol:	280.193949
ΔH_f, kcal/mol:	-4.2
Dipole, Da:	2.66
IP(EA), eV:	-9.3(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-[4-(3-phenylazetidin-1-yl)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

C1CNC[C@@H]1NC(=O)C2=CSC=N2

DOS

IR

Vibrations