Geometry & MOs

Info

ID:	189415
PubChem CID:	77853161
Reduced:	NO2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	395.233955
ΔH_f, kcal/mol:	-122.71
Dipole, Da:	3.91
IP(EA), eV:	-9.15(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[1-(2-chlorophenyl)piperidin-4-yl]-4-[[2-methoxyethyl(methyl)amino]methyl]pyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CN2CC34C=CC(O3)C(C4C2=O)C(=O)N(C)CCOC)C

DOS

IR

Vibrations