Geometry & MOs

Info

ID:	398886
PubChem CID:	135036039
Reduced:	NOH12C14 (2)
Stoich.:	ABC12D14 (2)
Weight, g/mol:	130.085255
ΔH_f, kcal/mol:	-3.14
Dipole, Da:	6.88
IP(EA), eV:	-8.36(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-[deuterio(propan-2-ylidene)azaniumyl]-1-methoxyethenolate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)NC4=CC=CC=C4C

DOS

IR

Vibrations