Geometry & MOs

Info

ID:	367337
PubChem CID:	127324226
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	322.182733
ΔH_f, kcal/mol:	-129.75
Dipole, Da:	4.03
IP(EA), eV:	-9.27(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)N2CCNC(=O)CC2C3=CC=CC=C3

DOS

IR

Vibrations