Geometry & MOs

Info

ID:	67154
PubChem CID:	46505965
Reduced:	N3O4C30H43 (1)
Stoich.:	A3B4C30D43 (1)
Weight, g/mol:	509.398128
ΔH_f, kcal/mol:	-211.84
Dipole, Da:	6.64
IP(EA), eV:	-9.6(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-adamantyl)-N-[1-[2-[bis(2-methylpropyl)amino]ethylamino]-3-methyl-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)N1CCC(CC1)NC(=O)C(C(C)C)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations