Geometry & MOs

Info

ID:	198916
PubChem CID:	79171349
Reduced:	ClOSN2C12H17 (1)
Stoich.:	ABCD2E12F17 (1)
Weight, g/mol:	227.199762
ΔH_f, kcal/mol:	-27.06
Dipole, Da:	2.22
IP(EA), eV:	-8.37(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-yl]methanamine

Drug info:

PubChemData

Smile

CN1CCOC(C1)CSC2=C(C=CC(=C2)N)Cl

DOS

IR

Vibrations