Geometry & MOs

Info

ID:	291179
PubChem CID:	111690089
Reduced:	IOSN4C20H31 (1)
Stoich.:	ABCD4E20F31 (1)
Weight, g/mol:	441.19646
ΔH_f, kcal/mol:	-10.63
Dipole, Da:	1.63
IP(EA), eV:	-8.25(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[N-[3-[di(propan-2-yl)amino]propyl]-N'-methylcarbamimidoyl]amino]-N-propylacetamide;hydroiodide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)NC=C2CCNC(=NC)NCC3(CCOCC3)SC.I

DOS

IR

Vibrations