Geometry & MOs

Info

ID:	284874
PubChem CID:	104079601
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	220.193949
ΔH_f, kcal/mol:	50.08
Dipole, Da:	5.42
IP(EA), eV:	-8.55(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-ethyl-3-N-methyl-1-N-pentan-2-ylbenzene-1,3-diamine

Drug info:

PubChemData

Smile

CCSCCCNC1=CC=CC(=C1)C2=CC=NN2

DOS

IR

Vibrations