Geometry & MOs

Info

ID:	420825
PubChem CID:	135114893
Reduced:	O2N3C23H31 (1)
Stoich.:	A2B3C23D31 (1)
Weight, g/mol:	434.173625
ΔH_f, kcal/mol:	-66.66
Dipole, Da:	2.63
IP(EA), eV:	-8.35(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4R,5S)-9-(2-amino-1,3-thiazole-4-carbonyl)-5-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl]-5-methyl-1H-imidazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCCN(CC1)CC(=O)N2CCC3(CC2)C4=C(CCO3)C5=CC=CC=C5N4

DOS

IR

Vibrations