Geometry & MOs

Info

ID:	225768
PubChem CID:	87225995
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	645.377786
ΔH_f, kcal/mol:	-165.15
Dipole, Da:	3.14
IP(EA), eV:	-9.7(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(dimethylamino)-2,2,4,4-tetramethylpentan-3-yl]-[(Z)-2-(naphthalen-1-yloxymethyl)-3-[4-(oxan-2-yloxycarbamoyl)phenyl]prop-2-enyl]carbamic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)NC=O

DOS

IR

Vibrations