Geometry & MOs

Info

ID:	263917
PubChem CID:	103407618
Reduced:	ClOSH11C16 (1)
Stoich.:	ABCD11E16 (1)
Weight, g/mol:	329.158013
ΔH_f, kcal/mol:	21.18
Dipole, Da:	3.26
IP(EA), eV:	-9.06(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-chloro-4-methylthiophen-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations