Geometry & MOs

Info

ID:	165929
PubChem CID:	74615130
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	427.247107
ΔH_f, kcal/mol:	-39.13
Dipole, Da:	4.75
IP(EA), eV:	-9.27(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[[2-[(dimethylamino)methyl]phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(=O)N(CCOC)CC2=NC(=O)C3C=CC=CC3=N2

DOS

IR

Vibrations