Geometry & MOs

Info

ID:	211696
PubChem CID:	81049769
Reduced:	N2O2C17H34 (1)
Stoich.:	A2B2C17D34 (1)
Weight, g/mol:	247.139471
ΔH_f, kcal/mol:	-136.16
Dipole, Da:	5.42
IP(EA), eV:	-8.77(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methyl-5-propan-2-yl-1-benzothiophen-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCC(CC)N(CCOC)C(=O)CC(C)C1CCCNC1

DOS

IR

Vibrations