Geometry & MOs

Info

ID:	147570
PubChem CID:	53787226
Reduced:	OSN2C16H20 (1)
Stoich.:	ABC2D16E20 (1)
Weight, g/mol:	199.103085
ΔH_f, kcal/mol:	-16.42
Dipole, Da:	3.68
IP(EA), eV:	-8.67(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1-[5-(2-methylsulfanylethyl)furan-2-yl]methanamine

Drug info:

PubChemData

Smile

CCN1CCC(CC1)C2=CC3=C(S2)C(=CC=C3)NC=O

DOS

IR

Vibrations