Geometry & MOs

Info

ID:	286677
PubChem CID:	104179678
Reduced:	ClNOSC16H18 (1)
Stoich.:	ABCDE16F18 (1)
Weight, g/mol:	283.116149
ΔH_f, kcal/mol:	1.77
Dipole, Da:	1.67
IP(EA), eV:	-9.14(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chlorophenyl)-N-(4-methylsulfanylbutyl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

C1C(CC1NCC(C2=CSC=C2)O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations