Geometry & MOs

Info

ID:	415794
PubChem CID:	135088795
Reduced:	N5O5C26H31 (1)
Stoich.:	A5B5C26D31 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	-40.92
Dipole, Da:	4.91
IP(EA), eV:	-8.78(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,4-dimethylphenyl)-N-(2-hydroxyethyl)-N-(1H-imidazol-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=O)NCCCCNC(=O)C3=C(C(=CC=C3)OC)OCC4=CN(CCCO2)N=N4

DOS

IR

Vibrations