Geometry & MOs

Info

ID:	214305
PubChem CID:	84975004
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-94.99
Dipole, Da:	4.11
IP(EA), eV:	-9.39(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[4-(dimethylamino)phenyl]methylamino]-2-oxoethyl]-3-phenylprop-2-enamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1(CCCCC1)C#N)N2CCCC(C2)C(=O)N

DOS

IR

Vibrations