Geometry & MOs

Info

ID:	151717
PubChem CID:	56269944
Reduced:	ClFO2N4C22H22 (1)
Stoich.:	ABC2D4E22F22 (1)
Weight, g/mol:	413.187005
ΔH_f, kcal/mol:	-40.32
Dipole, Da:	5.21
IP(EA), eV:	-9.16(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-N-[2-(dimethylamino)ethyl]-3-[(2-methylcyclopropanecarbonyl)amino]benzamide

Drug info:

PubChemData

Smile

CN(C)CCN(CC1=CC=C(C=C1)Cl)C(=O)C2=NN(C(=O)C=C2)C3=CC=C(C=C3)F

DOS

IR

Vibrations