Geometry & MOs

Info

ID:	432843
PubChem CID:	135172980
Reduced:	FON8H25C28 (1)
Stoich.:	ABC8D25E28 (1)
Weight, g/mol:	295.287515
ΔH_f, kcal/mol:	106.65
Dipole, Da:	3.33
IP(EA), eV:	-8.8(-2.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(Z)-heptadec-8-enyl]oxiran-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)C(NC1=CN=CC(=C1)C2=NC=C3C(=C2)/C(=C\4/N=C5C=NC=C(C5=N4)C6=CC=C(C=C6)F)/NN3)O

DOS

IR

Vibrations