Geometry & MOs

Info

ID:	265699
PubChem CID:	103540294
Reduced:	SN2O3C11H16 (1)
Stoich.:	AB2C3D11E16 (1)
Weight, g/mol:	170.141913
ΔH_f, kcal/mol:	-110.59
Dipole, Da:	9.23
IP(EA), eV:	-8.97(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxypyrrolidin-1-yl)butan-1-imine

Drug info:

PubChemData

Smile

CCC1=C(SC(=N1)N2CCC(C2)OC)C(=O)O

DOS

IR

Vibrations