Geometry & MOs

Info

ID:	226116
PubChem CID:	87325792
Reduced:	ClON6C25H25 (1)
Stoich.:	ABC6D25E25 (1)
Weight, g/mol:	223.120843
ΔH_f, kcal/mol:	83.31
Dipole, Da:	8.29
IP(EA), eV:	-9.17(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2-dimethoxy-2-phenylbutanamide

Drug info:

PubChemData

Smile

C1COCCN1CC2=CC=CC=C2C(C3=CC(=CC=C3)NC4=CC(=NC=N4)Cl)N5C=CN=C5

DOS

IR

Vibrations