Geometry & MOs

Info

ID:	338028
PubChem CID:	127258659
Reduced:	NO4H15C16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	217.167794
ΔH_f, kcal/mol:	-114.15
Dipole, Da:	5.23
IP(EA), eV:	-9.61(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxy-2,5,5-trimethylhexan-2-yl) carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C(C(=O)C2=CC=CC=C2)O)OC(=O)N

DOS

IR

Vibrations