Geometry & MOs

Info

ID:	164739
PubChem CID:	74444934
Reduced:	SO2N4C26H32 (1)
Stoich.:	AB2C4D26E32 (1)
Weight, g/mol:	366.180424
ΔH_f, kcal/mol:	2.71
Dipole, Da:	9.29
IP(EA), eV:	-8.53(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-3-ylmethyl)-N-[(4-methylphenyl)methyl]-4-(tetrazol-1-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=S)N(CCN2CCOCC2)CC3C=C4C=C(C=CC4=NC3=O)C)C

DOS

IR

Vibrations