Geometry & MOs

Info

ID:	170153
PubChem CID:	75205079
Reduced:	N2O2C25H28 (1)
Stoich.:	A2B2C25D28 (1)
Weight, g/mol:	433.146013
ΔH_f, kcal/mol:	-20.0
Dipole, Da:	5.29
IP(EA), eV:	-9.45(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxoprop-1-enyl]benzamide

Drug info:

PubChemData

Smile

C1CC1NC(=O)C2=CC=C(C=C2)C=CC(=O)N3CCC(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations