Geometry & MOs

Info

ID:	209878
PubChem CID:	80733911
Reduced:	NOSC17H29 (1)
Stoich.:	ABCD17E29 (1)
Weight, g/mol:	309.122107
ΔH_f, kcal/mol:	-63.17
Dipole, Da:	3.08
IP(EA), eV:	-8.76(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-methyl-4-(2-thiophen-2-ylethoxymethyl)thiophen-2-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCC1CCCC(C1)OCC2=C(SC(=C2)CNCC)C

DOS

IR

Vibrations