Geometry & MOs

Info

ID:	290849
PubChem CID:	111363288
Reduced:	ClISO2N4C17H22 (1)
Stoich.:	ABCD2E4F17G22 (1)
Weight, g/mol:	348.252526
ΔH_f, kcal/mol:	-29.74
Dipole, Da:	3.22
IP(EA), eV:	-8.7(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[N'-benzyl-N-[3-(2-methylpropoxy)propyl]carbamimidoyl]amino]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CCNC(=NCC(=O)NC1=CC=C(C=C1)O)N(C)CC2=CC=C(S2)Cl.I

DOS

IR

Vibrations