Geometry & MOs

Info

ID:	418726
PubChem CID:	135106647
Reduced:	ON3C10H13 (2)
Stoich.:	AB3C10D13 (2)
Weight, g/mol:	371.184506
ΔH_f, kcal/mol:	13.01
Dipole, Da:	8.3
IP(EA), eV:	-9.0(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(hydroxymethyl)cyclopropyl]methyl]-5-(4-methoxyphenyl)-3-pyrrolidin-1-yl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)C(=O)C2=C3C(=NOC3=NC4=C2CCC4)C

DOS

IR

Vibrations