Geometry & MOs

Info

ID:	342106
PubChem CID:	127264819
Reduced:	ON3C8H9 (2)
Stoich.:	AB3C8D9 (2)
Weight, g/mol:	323.184506
ΔH_f, kcal/mol:	11.99
Dipole, Da:	3.47
IP(EA), eV:	-9.29(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[(1-methyl-2-oxopyridine-4-carbonyl)amino]butyl]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C(N=C1C)N(C)CC2=NN=C3N2C=CC=C3

DOS

IR

Vibrations