Geometry & MOs

Info

ID:	189395
PubChem CID:	77849473
Reduced:	FN2O3C20H31 (1)
Stoich.:	AB2C3D20E31 (1)
Weight, g/mol:	376.247441
ΔH_f, kcal/mol:	-171.05
Dipole, Da:	3.12
IP(EA), eV:	-8.8(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[3-[[ethyl(2-hydroxyethyl)amino]methyl]-4-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CN(CC2CO)CC3=C(C=C(C=C3)OC)F

DOS

IR

Vibrations