Geometry & MOs

Info

ID:	132473
PubChem CID:	51366743
Reduced:	BrN4O4H19C23 (1)
Stoich.:	AB4C4D19E23 (1)
Weight, g/mol:	398.163043
ΔH_f, kcal/mol:	-28.21
Dipole, Da:	3.65
IP(EA), eV:	-8.55(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethoxyphenyl)imino-N-(2-methylphenyl)chromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)CN2C=C(C=CC2=O)C3=NC(=NO3)C4=CC=C(C=C4)Br

DOS

IR

Vibrations