Geometry & MOs

Info

ID:	290624
PubChem CID:	109776001
Reduced:	IO3N4C18H29 (1)
Stoich.:	AB3C4D18E29 (1)
Weight, g/mol:	399.15214
ΔH_f, kcal/mol:	-27.75
Dipole, Da:	3.86
IP(EA), eV:	-9.16(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(5-bromofuran-2-yl)ethyl]-3-ethyl-2-[[1-(2-methoxyethyl)cyclopentyl]methyl]guanidine

Drug info:

PubChemData

Smile

CN=C(NCC1=CC(=CC=C1)[N+](=O)[O-])NCC2(CCCC2)CCOC.I

DOS

IR

Vibrations