Geometry & MOs

Info

ID:	390091
PubChem CID:	134997014
Reduced:	ClN2H13C17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	395.118863
ΔH_f, kcal/mol:	87.4
Dipole, Da:	6.24
IP(EA), eV:	-9.33(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-but-3-enyl-6-methylphenyl)-N,2,2-trimethylpropanamide;carbon monoxide;chromium

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=CC=C3)Cl

DOS

IR

Vibrations