Geometry & MOs

Info

ID:	188830
PubChem CID:	77772314
Reduced:	N3O4C32H33 (1)
Stoich.:	A3B4C32D33 (1)
Weight, g/mol:	392.170922
ΔH_f, kcal/mol:	-72.79
Dipole, Da:	5.14
IP(EA), eV:	-9.06(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-carbamoylphenyl)-5-methyl-N-[4-(tetrazol-1-yl)phenyl]pyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(N(C(CO1)CC2=CC=CC=C2)NC(=O)CC(C3=CN(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5)C(=O)O)C

DOS

IR

Vibrations