Geometry & MOs

Info

ID:	158906
PubChem CID:	57244181
Reduced:	N2O2C21H36 (1)
Stoich.:	A2B2C21D36 (1)
Weight, g/mol:	300.241293
ΔH_f, kcal/mol:	-88.24
Dipole, Da:	4.51
IP(EA), eV:	-8.7(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-(2-methylpropylamino)-2-oxoheptan-3-yl]carbamate

Drug info:

PubChemData

Smile

CCC(C)(C)N(C1CCCCC1)C2=C(C(=NC=C2)COCC)OCC

DOS

IR

Vibrations