Geometry & MOs

Info

ID:	199237
PubChem CID:	79221971
Reduced:	N2S3C15H22 (1)
Stoich.:	A2B3C15D22 (1)
Weight, g/mol:	252.16602
ΔH_f, kcal/mol:	26.27
Dipole, Da:	2.97
IP(EA), eV:	-8.36(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N'-(2-phenylsulfanylethyl)-N'-propylethane-1,2-diamine

Drug info:

PubChemData

Smile

CSC1(CCN(CC1)CCSC2=CC=CC=C2)C(=S)N

DOS

IR

Vibrations