Geometry & MOs

Info

ID:	6529
PubChem CID:	68815
Reduced:	O5N7C16H19 (1)
Stoich.:	A5B7C16D19 (1)
Weight, g/mol:	389.144767
ΔH_f, kcal/mol:	-175.76
Dipole, Da:	7.91
IP(EA), eV:	-9.46(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-2,4-dioxo-1H-pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C(=O)[C@H](CC2=CN=CN2)NC(=O)C3=CC(=O)NC(=O)N3)C(=O)N

DOS

IR

Vibrations