Geometry & MOs

Info

ID:	291374
PubChem CID:	112166191
Reduced:	ISN5C18H34 (1)
Stoich.:	ABC5D18E34 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	7.67
Dipole, Da:	5.64
IP(EA), eV:	-8.44(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzofuran-2-ylmethyl)-1,2-dimethyl-3-[(E)-pent-3-enyl]guanidine

Drug info:

PubChemData

Smile

CCNC(=NCCCC(C)C)NCCC1=CSC(=N1)N2CCCC2.I

DOS

IR

Vibrations