Geometry & MOs

Info

ID:	175952
PubChem CID:	75973175
Reduced:	N4O5C26H32 (1)
Stoich.:	A4B5C26D32 (1)
Weight, g/mol:	480.23727
ΔH_f, kcal/mol:	-132.94
Dipole, Da:	9.23
IP(EA), eV:	-8.39(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethoxyphenyl)-3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-1,2,3,3a-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N2C(N1C)CC(N2)C3=CC=CC=C3OC)CCC(=O)NC4=C(C=C(C=C4)OC)OC

DOS

IR

Vibrations