Geometry & MOs

Info

ID:	202294
PubChem CID:	79652651
Reduced:	ON2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	264.16602
ΔH_f, kcal/mol:	-45.94
Dipole, Da:	2.96
IP(EA), eV:	-8.51(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2,3-dihydro-1-benzothiophen-3-ylmethyl)-N',2,2-trimethylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCCN(C)CC(C)(C)CN

DOS

IR

Vibrations