Geometry & MOs

Info

ID:	201113
PubChem CID:	79489886
Reduced:	SN2C18H32 (1)
Stoich.:	AB2C18D32 (1)
Weight, g/mol:	310.207885
ΔH_f, kcal/mol:	-13.38
Dipole, Da:	0.82
IP(EA), eV:	-8.59(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[[methyl(2-thiophen-2-ylethyl)amino]methyl]oxan-4-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCC1(CCCC1)CN(C)CCC2=CC=CS2

DOS

IR

Vibrations