Geometry & MOs

Info

ID:	344171
PubChem CID:	127267347
Reduced:	O2N5C17H29 (1)
Stoich.:	A2B5C17D29 (1)
Weight, g/mol:	302.13789
ΔH_f, kcal/mol:	-65.31
Dipole, Da:	4.35
IP(EA), eV:	-8.79(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(furan-2-yl)ethyl]-6-morpholin-4-ylpyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CCCN(C)C)NC(=O)C1=CC(=NC=N1)N2CCOCC2

DOS

IR

Vibrations