Geometry & MOs

Info

ID:	448579
PubChem CID:	135292070
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	297.184112
ΔH_f, kcal/mol:	-116.26
Dipole, Da:	3.21
IP(EA), eV:	-9.21(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(butan-2-ylamino)methyl]-N-(pyridin-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CCNCC1=CC=C(C=C1)C(=O)NCCOCCO

DOS

IR

Vibrations