Geometry & MOs

Info

ID:	170123
PubChem CID:	75199454
Reduced:	O4N5C26H39 (1)
Stoich.:	A4B5C26D39 (1)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-152.71
Dipole, Da:	6.37
IP(EA), eV:	-9.44(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-4-propan-2-yloxyphenyl)-N-[3-(propanoylamino)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CCCCCCCCCNC(=O)CN1C(=O)C2C(N=CN2CCOC)N(C1=O)CC3=CC=CC=C3

DOS

IR

Vibrations