Geometry & MOs

Info

ID:	199710
PubChem CID:	79285275
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-19.51
Dipole, Da:	4.73
IP(EA), eV:	-9.04(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(prop-2-enylamino)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1C)C(=O)CNCC=C

DOS

IR

Vibrations