Geometry & MOs

Info

ID:	209780
PubChem CID:	80722194
Reduced:	SN2C13H26 (1)
Stoich.:	AB2C13D26 (1)
Weight, g/mol:	303.165686
ΔH_f, kcal/mol:	-33.56
Dipole, Da:	3.23
IP(EA), eV:	-8.42(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-methyl-4-[(2-propan-2-ylphenoxy)methyl]thiophen-2-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CC1C(N(CCC1N)CC2(CCCS2)C)C

DOS

IR

Vibrations