Geometry & MOs

Info

ID:	216466
PubChem CID:	85086279
Reduced:	NO4C14H25 (1)
Stoich.:	AB4C14D25 (1)
Weight, g/mol:	271.214744
ΔH_f, kcal/mol:	-221.03
Dipole, Da:	1.31
IP(EA), eV:	-10.47(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(2,6,6-trimethyl-4-oxoheptan-3-yl)carbamate

Drug info:

PubChemData

Smile

CCC(C(C(C)C)C(=O)N1C(COC1=O)C(C)C)O

DOS

IR

Vibrations