Geometry & MOs

Info

ID:	306709
PubChem CID:	125165417
Reduced:	N2O4C25H32 (1)
Stoich.:	A2B4C25D32 (1)
Weight, g/mol:	328.178693
ΔH_f, kcal/mol:	-130.88
Dipole, Da:	5.32
IP(EA), eV:	-8.31(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methyl]-1-[(2S)-oxolan-2-yl]methanamine

Drug info:

PubChemData

Smile

C[C@H]1CN(CC2=C(O1)C=CC(=C2)C)CCC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

DOS

IR

Vibrations