Geometry & MOs

Info

ID:	427881
PubChem CID:	135164897
Reduced:	N3O3C20H27 (1)
Stoich.:	A3B3C20D27 (1)
Weight, g/mol:	367.225977
ΔH_f, kcal/mol:	-30.88
Dipole, Da:	0.9
IP(EA), eV:	-9.05(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-prop-2-enoxy-5-(2-pyridin-3-ylethoxy)phenyl]methyl]-1-pyrrolidin-3-ylmethanamine

Drug info:

PubChemData

Smile

CC1=CC(=NO1)COC2=CC(=CC(=C2)OCC=C)CNCC3CCNC3

DOS

IR

Vibrations