Geometry & MOs

Info

ID:	321568
PubChem CID:	126666622
Reduced:	O2N3C24H25 (1)
Stoich.:	A2B3C24D25 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-1.98
Dipole, Da:	6.62
IP(EA), eV:	-8.91(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,4R)-N-[(2,4-dimethoxyphenyl)methyl]-2-methyloxan-4-amine

Drug info:

PubChemData

Smile

CC1=NC2=C(N1C3CCOC(C3)COCC4=CC=CC=C4)C5=CC=CC=C5N=C2

DOS

IR

Vibrations