Geometry & MOs

Info

ID:	362873
PubChem CID:	127309702
Reduced:	O2N5C21H31 (1)
Stoich.:	A2B5C21D31 (1)
Weight, g/mol:	296.184841
ΔH_f, kcal/mol:	-60.3
Dipole, Da:	4.44
IP(EA), eV:	-8.52(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(N2)C3CCCN3C(=O)NCC4CCCN4CCOC

DOS

IR

Vibrations