Geometry & MOs

Info

ID:	77529
PubChem CID:	49649989
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	330.121572
ΔH_f, kcal/mol:	-75.64
Dipole, Da:	2.05
IP(EA), eV:	-9.2(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyano-3-cyclobutyl-3-oxopropanoyl)-2-methoxyphenoxy]acetamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)NC1=CC=CC=C1C(=O)C(C#N)C(=O)C2CCC2

DOS

IR

Vibrations