Geometry & MOs

Info

ID:	433265
PubChem CID:	135173402
Reduced:	N5O5C19H29 (1)
Stoich.:	A5B5C19D29 (1)
Weight, g/mol:	232.084792
ΔH_f, kcal/mol:	-221.78
Dipole, Da:	7.02
IP(EA), eV:	-8.95(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxyanilino)-4-(methylamino)cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N/C(=N\C(=O)OC(C)(C)C)/NC1=CC(=CC=C1)NC(=O)NC

DOS

IR

Vibrations