Geometry & MOs

Info

ID:	246358
PubChem CID:	103059367
Reduced:	BrON3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	31.13
Dipole, Da:	2.44
IP(EA), eV:	-8.81(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-[(4-methoxy-N-methylanilino)methyl]oxan-4-amine

Drug info:

PubChemData

Smile

CNC1=NC=C(N=C1)COCC2=CC=C(C=C2)Br

DOS

IR

Vibrations