Geometry & MOs

Info

ID:	123608
PubChem CID:	50855582
Reduced:	OS2N4C16H16 (1)
Stoich.:	AB2C4D16E16 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	61.11
Dipole, Da:	6.28
IP(EA), eV:	-8.54(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1,5-dimethylpyrrol-2-yl)methylideneamino]-2-(3-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(N1C)/C=N\NC(=O)CSC2=NC3=CC=CC=C3S2

DOS

IR

Vibrations