Geometry & MOs

Info

ID:	448585
PubChem CID:	135292097
Reduced:	FO3N5C25H30 (1)
Stoich.:	AB3C5D25E30 (1)
Weight, g/mol:	350.256943
ΔH_f, kcal/mol:	-71.1
Dipole, Da:	2.44
IP(EA), eV:	-8.96(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-pentoxyethoxy)ethyl]-4-[(propan-2-ylamino)methyl]benzamide

Drug info:

PubChemData

Smile

CC1CN(CCN1C(=O)CCOC)C2=C(C=C(C(=N2)C3CC3)C4=CC=C(C=C4)F)C(=N)OC=N

DOS

IR

Vibrations