Geometry & MOs

Info

ID:	273722
PubChem CID:	103799409
Reduced:	NO5C15H17 (1)
Stoich.:	AB5C15D17 (1)
Weight, g/mol:	281.199094
ΔH_f, kcal/mol:	-178.59
Dipole, Da:	5.64
IP(EA), eV:	-9.67(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)adamantane-1-carboxamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C1=CC2=CC=CC=C2OC1=O

DOS

IR

Vibrations