Geometry & MOs

Info

ID:	407071
PubChem CID:	135079274
Reduced:	NO3C19H21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	335.152144
ΔH_f, kcal/mol:	-69.84
Dipole, Da:	1.42
IP(EA), eV:	-8.64(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(4-methoxyphenyl)imino-4-phenylbut-3-ynoate

Drug info:

PubChemData

Smile

CCOC(=O)C(=NC1=CC=C(C=C1)OC)CCC2=CC=CC=C2

DOS

IR

Vibrations