Geometry & MOs

Info

ID:	126588
PubChem CID:	50968990
Reduced:	O2N4H16C17 (1)
Stoich.:	A2B4C16D17 (1)
Weight, g/mol:	359.232125
ΔH_f, kcal/mol:	32.21
Dipole, Da:	7.49
IP(EA), eV:	-9.18(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(methoxymethyl)-N-[3-(5-methyltetrazol-2-yl)-1-adamantyl]cyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C2CC(=O)N=C3C2=C(NN3)C4=CN=CC=C4

DOS

IR

Vibrations