Geometry & MOs

Info

ID:	415209
PubChem CID:	135088201
Reduced:	O5N6C30H40 (1)
Stoich.:	A5B6C30D40 (1)
Weight, g/mol:	356.151826
ΔH_f, kcal/mol:	-190.02
Dipole, Da:	9.95
IP(EA), eV:	-9.67(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-propan-2-ylpyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC[C@H]1CN(CC(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=CC=C2)CC(C)C)C)C(=O)C3=CC=NC=C3

DOS

IR

Vibrations