Geometry & MOs

Info

ID:	440536
PubChem CID:	135230522
Reduced:	F2O3N8C27H28 (1)
Stoich.:	A2B3C8D27E28 (1)
Weight, g/mol:	153.15175
ΔH_f, kcal/mol:	-45.46
Dipole, Da:	9.37
IP(EA), eV:	-9.24(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,4,4-triethylbicyclo[1.1.0]butan-2-amine

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CN=C(N=C2)C)C3=CC=CC=C3)NC(=O)N[C@@H]4CN(O[C@H]4C5=CC(=C(N=C5)F)F)CCOC

DOS

IR

Vibrations