Geometry & MOs

Info

ID:	201105
PubChem CID:	79489878
Reduced:	SN2C18H32 (1)
Stoich.:	AB2C18D32 (1)
Weight, g/mol:	366.07653
ΔH_f, kcal/mol:	-6.32
Dipole, Da:	1.26
IP(EA), eV:	-8.73(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromophenyl)-N,N'-dimethyl-N'-(2-thiophen-2-ylethyl)propane-1,3-diamine

Drug info:

PubChemData

Smile

CCCNC1CCCCCC1CN(C)CCC2=CC=CS2

DOS

IR

Vibrations