Geometry & MOs

Info

ID:	140617
PubChem CID:	52730780
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	-41.61
Dipole, Da:	7.37
IP(EA), eV:	-9.12(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-carbamoylphenyl)-4-[(prop-2-enoylamino)methyl]benzamide

Drug info:

PubChemData

Smile

C1CCN(C1)CC2=CC(=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)N

DOS

IR

Vibrations