Geometry & MOs

Info

ID:	18687
PubChem CID:	546402
Reduced:	NO3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	243.183444
ΔH_f, kcal/mol:	-173.98
Dipole, Da:	2.53
IP(EA), eV:	-9.84(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(1-hydroxy-6-methylhept-2-en-4-yl)carbamate

Drug info:

PubChemData

Smile

CC(C)CC(C=CCO)NC(=O)OC(C)(C)C

DOS

IR

Vibrations