Geometry & MOs

Info

ID:	265623
PubChem CID:	103533751
Reduced:	SN2O2C14H20 (1)
Stoich.:	AB2C2D14E20 (1)
Weight, g/mol:	231.158292
ΔH_f, kcal/mol:	-49.87
Dipole, Da:	7.87
IP(EA), eV:	-8.34(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dimethoxypyrrolidin-1-yl)-N'-hydroxy-2-methylpropanimidamide

Drug info:

PubChemData

Smile

COC1CN(CC1OC)CC2=CC=CC=C2C(=S)N

DOS

IR

Vibrations