Geometry & MOs

Info

ID:	326314
PubChem CID:	126687318
Reduced:	FN3C10H18 (1)
Stoich.:	AB3C10D18 (1)
Weight, g/mol:	414.1092
ΔH_f, kcal/mol:	-38.42
Dipole, Da:	3.84
IP(EA), eV:	-8.43(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-[(Z)-[(2R)-3-amino-2-fluoro-3-methylbutylidene]amino]-2-N-(1-fluoroethyl)-5-iodo-1-N-methyl-3-methylidenepent-1-ene-1,2-diamine

Drug info:

PubChemData

Smile

CCCC(CC)C1NC(=C(C=N1)F)N

DOS

IR

Vibrations