Geometry & MOs

Info

ID:	72441
PubChem CID:	48416179
Reduced:	N2O5C23H34 (1)
Stoich.:	A2B5C23D34 (1)
Weight, g/mol:	382.164105
ΔH_f, kcal/mol:	-237.49
Dipole, Da:	5.1
IP(EA), eV:	-8.88(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-ethoxyphenyl)methyl]-3-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2CCCN(C2)C(=O)C(C)C)C(=O)OC

DOS

IR

Vibrations