Geometry & MOs

Info

ID:	185408
PubChem CID:	77297224
Reduced:	ClNO4C16H16 (1)
Stoich.:	ABC4D16E16 (1)
Weight, g/mol:	290.163043
ΔH_f, kcal/mol:	-123.27
Dipole, Da:	4.48
IP(EA), eV:	-9.91(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-cyclobutyl-6-methyl-2-oxopyridin-3-ylidene)-2,2-dimethylpropyl]carbamic acid

Drug info:

PubChemData

Smile

C1CC(CC(C1)(C(=O)N)C(=O)O)(C#CC2=CC(=CC=C2)Cl)O

DOS

IR

Vibrations