Geometry & MOs

Info

ID:	445717
PubChem CID:	135269080
Reduced:	SN4O4C24H28 (1)
Stoich.:	AB4C4D24E28 (1)
Weight, g/mol:	262.240899
ΔH_f, kcal/mol:	-115.57
Dipole, Da:	7.1
IP(EA), eV:	-9.17(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[(Z)-5-methyl-4-[(Z)-prop-1-enyl]oct-4-en-2-yl]-1-N'-prop-1-en-2-ylethene-1,1-diamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC2=NC3=C(CCC2CC4=NC=C(S4)C)C(=O)N(C(=O)N3C)CCCO

DOS

IR

Vibrations